{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1126891 1.464287 0.6414025 ] [ 1.365449 0.1265984 2.502806 ] [ 0.3364486 2.37729 2.80341 ] [ 2.851665 1.424041 0.0715282 ] [ 2.597469 0.5436052 1.609588 ] [ 2.328633 2.330176 2.375244 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.126891e-11 1.464287e-10 6.414025e-11 ] [ 1.365449e-10 1.265984e-11 2.502806e-10 ] [ 3.364486e-11 2.37729e-10 2.80341e-10 ] [ 2.851665e-10 1.424041e-10 7.15282e-12 ] [ 2.597469e-10 5.436052e-11 1.609588e-10 ] [ 2.328633e-10 2.330176e-10 2.375244e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6951778 -0.26947 0.0189348 ] [ -28.8364775 -9.0836298 19.7115087 ] [ -4.243268 -0.0739011 0.8303251 ] [ 0.775087 7.3864399 -12.424585 ] [ 27.971338 -4.80019 -10.1259068 ] [ 3.6381427 6.840751 1.9897232 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.113797627635525e-09 -4.317385375639799e-10 3.03368941294632e-11 ] [ -4.620113045736674e-08 -1.455357941746609e-08 3.158131866002771e-08 ] [ -6.798464841399912e-09 -1.184026156468974e-10 1.330327473843713e-09 ] [ 1.241826280717158e-09 1.18343814162253e-08 -1.990637977414689e-08 ] [ 4.481502416531629e-08 -7.69075225676046e-09 -1.622349127302171e-08 ] [ 5.828947225097672e-09 1.096009141121213e-08 3.187888019167708e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.1294654 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.616132974791464e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1366781 1.335848 0.5742428 ] [ 0.7716188 -0.065327 2.4208721 ] [ 0.4537422 2.2933231 2.7557891 ] [ 2.4261027 1.7152789 0.0749661 ] [ 3.061043 0.3141144 1.9215938 ] [ 2.7431689 2.6727601 2.2565147 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.366781e-11 1.335848e-10 5.742428000000001e-11 ] [ 7.716188000000001e-11 -6.5327e-12 2.4208721e-10 ] [ 4.537422e-11 2.2933231e-10 2.7557891e-10 ] [ 2.4261027e-10 1.7152789e-10 7.49661e-12 ] [ 3.061043e-10 3.141144e-11 1.9215938e-10 ] [ 2.7431689e-10 2.6727601e-10 2.2565147e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.8e-06 -2.62e-05 2.1e-05 ] [ -1.88e-05 4.2e-06 -1.33e-05 ] [ 1.2e-06 4.9e-06 1.25e-05 ] [ 1.95e-05 1.05e-05 -1.18e-05 ] [ -8e-06 -1.38e-05 -5.9e-06 ] [ -1.6e-06 2.03e-05 -2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.24969777452e-14 -4.197702781079999e-14 3.364570931399999e-14 ] [ -3.012092071919999e-14 6.729141862799999e-15 -2.13089492322e-14 ] [ 1.9226119608e-15 7.850665506599998e-15 2.0027207925e-14 ] [ 3.1242444363e-14 1.6822854657e-14 -1.89056842812e-14 ] [ -1.2817413072e-14 -2.21100375492e-14 -9.452842140600001e-15 ] [ -2.5634826144e-15 3.252418567019999e-14 -4.005441585e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.513765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.806014505636701e-18 } }